GD089394

Name:

None

Formula:

C19H28O8N4

Smiles:

CC(=O)OC[C@H]1O[C@H](O)[C@H](n2cc([C@H]3CCCCN3)nn2)[C@@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:

C1=C(C2CCCCN2)N=N[N]1.COC(C)=O

Sugarmoiety:

CC(=O)OC1C(O)OC(O)C(O)C1OC(C)=O

Other Identifiers

• ZINC001246063888

AD00017

Formula: C3H6O2

Smiles:

COC(C)=O

HBA:	2	RingCount:	0
HBD:	0	FractionCSP3:	0.67
AlogP:	0.18	Num_rotatable_bonds:	0
MolWt:	74.08	Num_heavy_atoms:	5
TPSA:	26.3	NumAromaticRings:	0

AD38998

Formula: C7H11N4

Smiles:

C1=C(C2CCCCN2)N=N[N]1

HBA:	4	RingCount:	2
HBD:	1	FractionCSP3:	0.71
AlogP:	0.96	Num_rotatable_bonds:	1
MolWt:	151.19	Num_heavy_atoms:	11
TPSA:	50.85	NumAromaticRings:	0